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methyl 2-{[(2-methylphenoxy)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
SpectraBase Compound ID 4xOq4U3hYXR
InChI InChI=1S/C20H23NO4S/c1-13-8-6-7-10-15(13)25-12-17(22)21-19-18(20(23)24-2)14-9-4-3-5-11-16(14)26-19/h6-8,10H,3-5,9,11-12H2,1-2H3,(H,21,22)
InChIKey LALXGLGYXBSQTN-UHFFFAOYSA-N
Mol Weight 373.47 g/mol
Molecular Formula C20H23NO4S
Exact Mass 373.134779 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Et4fB1mppWZ
Name methyl 2-{[(2-methylphenoxy)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C20H23NO4S/c1-13-8-6-7-10-15(13)25-12-17(22)21-19-18(20(23)24-2)14-9-4-3-5-11-16(14)26-19/h6-8,10H,3-5,9,11-12H2,1-2H3,(H,21,22)
InChIKey LALXGLGYXBSQTN-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13228
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/9065975; UBI_ID: UBI-013231
Temperature 308 °C